3-[4-(2-methylaziridin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(2-methylaziridin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(2-methylaziridin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-(2-methyl-1-aziridinyl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2-methylaziridin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(2-methylethylenimin-1-yl)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C14H12F3N3O MolecularWeight: 295.25979

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN1C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CC1CN1C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C14H12F3N3O/c1-8-7-20(8)12-4-2-9(6-10(12)14(15,16)17)11-3-5-13(21)19-18-11/h2-6,8H,7H2,1H3,(H,19,21)